Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02050047
You can sort the columns by Ligand, Ligand name, PDB and Tanimoto.
You can sort the columns by Ligand, Ligand name, PDB and Tanimoto.
Ligand | Ligand name | Chain | PDB | Tanimoto | Ligand in PDB |
---|---|---|---|---|---|
Ligand | Ligand name | Chain | PDB | Tanimoto | Ligand in PDB |
TMF![]() | 5,10-METHYLENE-6-HYDROFOLIC ACID | A | 1BJG | 0.73 | ![]() |
TMF![]() | 5,10-METHYLENE-6-HYDROFOLIC ACID | A | 1JBW | 0.73 | ![]() |
TMF![]() | 5,10-METHYLENE-6-HYDROFOLIC ACID | A | 1LCE | 0.73 | ![]() |
BFB![]() | N-[(1S)-1-(AMINOCARBONYL)-4-(ETHANIMIDOYLAMINO)BUTYL]BENZAMIDE | A | 2DW5 | 0.72 | ![]() |
TGF![]() | 2-[4-(4-{4-[(2-AMINO-5-FORMYL-4- OXO-3,4,5,6,7,8-HEXAHYDRO-PTERIDIN- 6-YLMETHYL)-AMINO]-BENZOYLAMINO}- 4-CARBOXY-BUTYRYLAMINO)-4-CARBOXY- BUTYRYLAMINO]-PENTANEDIOIC ACID | A,B,C,D | 1LS3 | 0.73 | ![]() |
CB1![]() | 5-(AZIRIDIN-1-YL)-2,4-DINITROBENZAMIDE | A,B | 1XI2 | 0.7 | ![]() |
CB1![]() | 5-(AZIRIDIN-1-YL)-2,4-DINITROBENZAMIDE | A,B | 1ZX1 | 0.7 | ![]() |
CB1![]() | 5-(AZIRIDIN-1-YL)-2,4-DINITROBENZAMIDE | A,B | 1IDT | 0.7 | ![]() |
CB1![]() | 5-(AZIRIDIN-1-YL)-2,4-DINITROBENZAMIDE | A,B | 2BZS | 0.7 | ![]() |
LFN![]() | LUMIFLAVIN | A | 2CCC | 0.7 | ![]() |
XX4![]() | 3-(2-AMINO-6-BENZOYLQUINAZOLIN- 3(4H)-YL)-N-CYCLOHEXYL-N-METHYLPROPANAMIDE | A,B,C | 2Q11 | 0.76 | ![]() |
BAN![]() | HONH-BENZYLMALONYL-L-ALANYLGLYCINE- P-NITROANILIDE | A | 5TLN | 0.7 | ![]() |
C2F![]() | 5-METHYL-5,6,7,8-TETRAHYDROFOLIC ACID | A | 1U1J | 0.77 | ![]() |
C2F![]() | 5-METHYL-5,6,7,8-TETRAHYDROFOLIC ACID | A,B | 2OGY | 0.77 | ![]() |
C2F![]() | 5-METHYL-5,6,7,8-TETRAHYDROFOLIC ACID | A,B | 1XPG | 0.77 | ![]() |
C2F![]() | 5-METHYL-5,6,7,8-TETRAHYDROFOLIC ACID | A,B | 1TLS | 0.77 | ![]() |
C2F![]() | 5-METHYL-5,6,7,8-TETRAHYDROFOLIC ACID | A,B,C | 1ZP4 | 0.77 | ![]() |
C2F![]() | 5-METHYL-5,6,7,8-TETRAHYDROFOLIC ACID | A,B | 2E7F | 0.77 | ![]() |
C2F![]() | 5-METHYL-5,6,7,8-TETRAHYDROFOLIC ACID | A | 1TSN | 0.77 | ![]() |
C2F![]() | 5-METHYL-5,6,7,8-TETRAHYDROFOLIC ACID | A,B | 2IDK | 0.77 | ![]() |
C2F![]() | 5-METHYL-5,6,7,8-TETRAHYDROFOLIC ACID | A,B | 1XR2 | 0.77 | ![]() |
C2F![]() | 5-METHYL-5,6,7,8-TETRAHYDROFOLIC ACID | A | 1B02 | 0.77 | ![]() |
C2F![]() | 5-METHYL-5,6,7,8-TETRAHYDROFOLIC ACID | A,B | 1Q8J | 0.77 | ![]() |
RA4![]() | N-(4-NITROBENZOYL)-L-LEUCYL-N-(4- {[AMINO(IMINO)METHYL]AMINO}BUTYL)- L-PROLINAMIDE | H,I | 1YPM | 0.81 | ![]() |
XXZ![]() | 1-[4-(AMINOMETHYL)BENZOYL]-5'-FLUORO- 1'H-SPIRO[PIPERIDINE-4,2'-QUINAZOLIN]- 4'-AMINE | A,B | 3E65 | 0.72 | ![]() |
THG![]() | (6S)-5,6,7,8-TETRAHYDROFOLATE | A,B | 1KZI | 0.75 | ![]() |
THG![]() | (6S)-5,6,7,8-TETRAHYDROFOLATE | A | 1M7Z | 0.75 | ![]() |
THG![]() | (6S)-5,6,7,8-TETRAHYDROFOLATE | A | 3BHR | 0.75 | ![]() |
THG![]() | (6S)-5,6,7,8-TETRAHYDROFOLATE | A | 3GSI | 0.75 | ![]() |
THG![]() | (6S)-5,6,7,8-TETRAHYDROFOLATE | A | 1M7V | 0.75 | ![]() |
THG![]() | (6S)-5,6,7,8-TETRAHYDROFOLATE | A,B | 3BHL | 0.75 | ![]() |
THG![]() | (6S)-5,6,7,8-TETRAHYDROFOLATE | A | 1U22 | 0.75 | ![]() |
FON![]() | FOLINIC ACID | A,B | 1QD1 | 0.75 | ![]() |
FON![]() | FOLINIC ACID | A,B | 2BLN | 0.75 | ![]() |
FON![]() | FOLINIC ACID | A,B,C,D | 1VRQ | 0.75 | ![]() |
FON![]() | FOLINIC ACID | A,B | 1KL2 | 0.75 | ![]() |
FON![]() | FOLINIC ACID | A,B | 1XZQ | 0.75 | ![]() |
MHF![]() | 5,10-METHENYL-6,7,8-TRIHYDROFOLIC ACID | X | 2IJG | 0.72 | ![]() |
MHF![]() | 5,10-METHENYL-6,7,8-TRIHYDROFOLIC ACID | A,B | 2J4D | 0.72 | ![]() |
MHF![]() | 5,10-METHENYL-6,7,8-TRIHYDROFOLIC ACID | A,B | 1DNP | 0.72 | ![]() |
SY1![]() | 2-({2-[(3R)-3-AMINOPIPERIDIN-1- YL]-4-OXOQUINAZOLIN-3(4H)-YL}METHYL)BENZONITRILE | A,B,C,D | 2ONC | 0.71 | ![]() |
MEF![]() | N-({4-[(6aR)-3-amino-1-oxo-1,2,5,6,6a,7- hexahydroimidazo[1,5-f]pteridin- 8(9H)-yl]phenyl}carbonyl)-L-glutamic acid | A | 3BGX | 0.73 | ![]() |
FRM![]() | 2-{3-[4-(4-FLUOROPHENYL)-3,6-DIHYDRO- 1(2H)-PYRIDINYL]PROPYL}-8-METHYL- 4(3H)-QUINAZOLINONE | A,B | 1UK0 | 0.76 | ![]() |
TFI![]() | 2-[5-METHANESULFONYLAMINO-2-(4- AMINOPHENYL)-6-OXO-1,6-DIHYDRO- 1-PYRIMIDINYL]-N-(3,3,3-TRIFLUORO- 1-ISOPROPYL-2-OXOPROPYL)ACETAMIDE | A | 1EAT | 0.73 | ![]() |
FFO![]() | 5-FORMYL-6-HYDROFOLIC ACID | A,B,C,D | 1EQB | 0.76 | ![]() |
FFO![]() | 5-FORMYL-6-HYDROFOLIC ACID | A | 1JOM | 0.76 | ![]() |
FFO![]() | 5-FORMYL-6-HYDROFOLIC ACID | A | 1PJ7 | 0.76 | ![]() |
FFO![]() | 5-FORMYL-6-HYDROFOLIC ACID | A,B,C,D | 1DFO | 0.76 | ![]() |
FFO![]() | 5-FORMYL-6-HYDROFOLIC ACID | A,B | 2VMY | 0.76 | ![]() |
FFO![]() | 5-FORMYL-6-HYDROFOLIC ACID | A,B | 1JOL | 0.76 | ![]() |
FFO![]() | 5-FORMYL-6-HYDROFOLIC ACID | A | 1WOP | 0.76 | ![]() |
THL![]() | N-[4-({[(6S)-2-AMINO-4-OXO-1,4,5,6,7,8- HEXAHYDROPTERIDIN-6-YL]METHYL}AMINO)BENZOYL]- L-GLUTAMIC ACID | A | 3G5R | 0.75 | ![]() |
THL![]() | N-[4-({[(6S)-2-AMINO-4-OXO-1,4,5,6,7,8- HEXAHYDROPTERIDIN-6-YL]METHYL}AMINO)BENZOYL]- L-GLUTAMIC ACID | A | 1WOO | 0.75 | ![]() |
AQO![]() | 2-AMINOQUINAZOLIN-4(3H)-ONE | A | 1S39 | 0.72 | ![]() |
1A2![]() | 5-(4'-AMINO-1'-ETHYL-5',8'-DIFLUORO- 1'H-SPIRO[PIPERIDINE-4,2'-QUINAZOLINE]- 1-YLCARBONYL)PICOLINONITRILE | A,B | 3E6T | 0.7 | ![]() |
DQB![]() | 4-[(4-{[(2-AMINO-4-OXO-3,4-DIHYDROQUINAZOLIN- 6-YL)METHYL]AMINO}BENZOYL)AMINO]BUTANOIC ACID | A | 1ZLY | 0.72 | ![]() |
THF![]() | 5-HYDROXYMETHYLENE-6-HYDROFOLIC ACID | A,B,C,D | 1EJI | 0.76 | ![]() |
THF![]() | 5-HYDROXYMETHYLENE-6-HYDROFOLIC ACID | A | 1U3G | 0.76 | ![]() |
THF![]() | 5-HYDROXYMETHYLENE-6-HYDROFOLIC ACID | A | 2TDD | 0.76 | ![]() |
DHF![]() | DIHYDROFOLIC ACID | A,B,C,D,E | 3DL5 | 0.75 | ![]() |
DHF![]() | DIHYDROFOLIC ACID | A | 1LCB | 0.75 | ![]() |
DHF![]() | DIHYDROFOLIC ACID | A,B,C,D | 1MXH | 0.75 | ![]() |
DHF![]() | DIHYDROFOLIC ACID | A | 2RK1 | 0.75 | ![]() |
DHF![]() | DIHYDROFOLIC ACID | A | 1RF7 | 0.75 | ![]() |
DHF![]() | DIHYDROFOLIC ACID | A,B,C,D,E | 3DL6 | 0.75 | ![]() |
DHF![]() | DIHYDROFOLIC ACID | A | 1TYS | 0.75 | ![]() |